CID 3136155

1-(2-chlorophenylcarbamoyl)-2-methylpiperidine

Structural Information

Molecular Formula
C13H17ClN2O
SMILES
CC1CCCCN1C(=O)NC2=CC=CC=C2Cl
InChI
InChI=1S/C13H17ClN2O/c1-10-6-4-5-9-16(10)13(17)15-12-8-3-2-7-11(12)14/h2-3,7-8,10H,4-6,9H2,1H3,(H,15,17)
InChIKey
JOMCYQADESGDAR-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)-2-methylpiperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

252.10294 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.110216 157.5
[M+Na]+ 275.092158 163.4
[M-H]- 251.095664 162.0
[M+NH4]+ 270.136763 173.7
[M+K]+ 291.066098 158.7
[M+H-H2O]+ 235.100200 150.1
[M+HCOO]- 297.101141 172.5
[M+CH3COO]- 311.116791 194.3
[M+Na-2H]- 273.077606 160.3
[M]+ 252.10239142 154.6
[M]- 252.10348858 154.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.